Propanoic acid,3,3'-sulfinylbis-, didodecyl ester (9CI) supplier

Name
didodecyl 3,3'-sulphinylbispropionate
EINECS 241-276-4
CAS No. 17243-14-0
Density 0.982g/cm³
Solubility
Melting Point
Formula C₃₀H₅₈O₅S
Boiling Point 628.6 °C at 760 mmHg
Molecular Weight 530.854
Flash Point 333.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Propionicacid, 3,3'-sulfinyldi-, didodecyl ester (8CI);Didodecyl3,3'-sulfinyldipropionate;Dilauryl sulfinyl-b,b'-dipropionate;
PSA 88.88000
LogP 9.30920

Propanoic acid,3,3'-sulfinylbis-, didodecyl ester (9CI) Specification

The Propanoic acid,3,3'-sulfinylbis-, didodecyl ester (9CI), with CAS registry number 17243-14-0, has the systematic name of didodecyl 3,3'-sulfinyldipropanoate. Besides this, it is also called 3,3'-Sulfinylbis(propionic acid dodecyl) ester. And the chemical formula of this chemical is C₃₀H₅₈O₅S. What's more, its EINECS is 241-276-4.

Physical properties of Propanoic acid,3,3'-sulfinylbis-, didodecyl ester (9CI): (1)ACD/LogP: 11.03; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 11.03; (4)ACD/LogD (pH 7.4): 11.03; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 30; (12)Polar Surface Area: 88.88 Å²; (13)Index of Refraction: 1.479; (14)Molar Refractivity: 153.44 cm³; (15)Molar Volume: 540.2 cm³; (16)Polarizability: 60.83×10^-24cm³; (17)Surface Tension: 38.5 dyne/cm; (18)Density: 0.982 g/cm³; (19)Flash Point: 333.9 °C; (20)Enthalpy of Vaporization: 93 kJ/mol; (21)Boiling Point: 628.6 °C at 760 mmHg; (22)Vapour Pressure: 1.03E-15 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCCCCCCCCCCCC)CCS(=O)CCC(=O)OCCCCCCCCCCCC
(2)InChI: InChI=1/C30H58O5S/c1-3-5-7-9-11-13-15-17-19-21-25-34-29(31)23-27-36(33)28-24-30(32)35-26-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
(3)InChIKey: XQQARSOXXGMYHZ-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C30H58O5S/c1-3-5-7-9-11-13-15-17-19-21-25-34-29(31)23-27-36(33)28-24-30(32)35-26-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3
(5)Std. InChIKey: XQQARSOXXGMYHZ-UHFFFAOYSA-N

Product Name

didodecyl 3,3'-sulphinylbispropionate

Propanoic acid,3,3'-sulfinylbis-, didodecyl ester (9CI) Specification

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